Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5146747 | 0.81 | XDH (0.43) | ALDH1A1LMNASMN1; SMN2NFE2L2HTT | |
| SCHEMBL11286333 | 0.78 | TSHR (0.45) | TSHRALDH1A1TDP1LMNASMN1; SMN2 | |
| SCHEMBL458041 | 0.72 | POLB (0.43) | TSHRALDH1A1TDP1LMNAPOLB | |
| SCHEMBL11742163 | 0.71 | HTT (0.40) | TSHRALDH1A1TDP1LMNACYP1A2 | |
| SCHEMBL2154099 | 0.70 | KMT2A (0.48) | ALDH1A1TDP1LMNANFE2L2HTT | |
| SCHEMBL3722491 | 0.70 | RIPK1 (0.45) | TSHRALDH1A1LMNAPOLBSMN1; SMN2 | |
| SCHEMBL231178 | 0.69 | KDM4E (0.42) | TSHRALDH1A1TDP1LMNAPOLB | |
| SCHEMBL7150017 | 0.69 | POLB (0.39) | ALDH1A1LMNAPOLBSMN1; SMN2CYP1A2 | |
| SCHEMBL5742336 | 0.69 | HTT (0.38) | TSHRALDH1A1TDP1LMNASMN1; SMN2 | |
| SCHEMBL6377117 | 0.69 | TSHR (0.49) | TSHRALDH1A1TDP1LMNACYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1242059-B1 | NOVEL PRODRUGS FOR ANTIMICROBIAL AMIDINES | UNIV NORTH CAROLINA (US) | 2007-03-21 | — | — | EP | claimed |
| WO-2010038465-A1 | 8-SUBSTITUTED ISOQUINOLINE DERIVATIVE AND USE THEREOF | 旭化成ファーマ株式会社 (JP) | 2010-04-08 | — | — | WO | disclosed |